Conical intersections and non-adiabatic dynamics in push-pull quinodimethanes

被引：0
|
作者：
Oppel, Markus [1 ]
Obaid, Rana [1 ,2 ]
Deeb, Omar [2 ]
Zilberg, Shmuel [3 ,4 ]
Gonzalez, Leticia [1 ]
机构：
[1] Univ Vienna, Dept Theoret Chem, Vienna, Austria
[2] Al Quds Univ, Fac Pharm, Al Quds, Israel
[3] Hebrew Univ Jerusalem, Dept Phys Chem, IL-91904 Jerusalem, Israel
[4] Hebrew Univ Jerusalem, Farkas Ctr Light Induced Proc, Jerusalem, Israel
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2012年 / 244卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
390-PHYS
引用
收藏
页数：1
相关论文
共 50 条
  • [21] Photoreactivity of a Push-Pull Merocyanine in Static Electric Fields: A Three-State Model of Isomerization Reactions Involving Conical Intersections
    Xu, X. F.
    Kahan, A.
    Zilberg, S.
    Haas, Y.
    JOURNAL OF PHYSICAL CHEMISTRY A, 2009, 113 (36): : 9779 - 9791
  • [22] Ab initio non-adiabatic coupling elements:: Conical intersections of the C2H2 molecule
    Halász, GJ
    Vibók, K
    Baer, M
    CHEMICAL PHYSICS LETTERS, 2005, 413 (1-3) : 226 - 230
  • [23] Non-adiabatic molecular dynamics simulations
    Parker, Shane
    Muuronen, Mikko
    Vincent, Jordan
    Roy, Saswata
    Krull, Brandon
    Yu, Jason
    Nguyen, Brian
    Furche, Filipp
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 251
  • [24] Non-adiabatic effects in chemical dynamics
    Tully, JC
    FARADAY DISCUSSIONS, 2004, 127 : 463 - 466
  • [25] Non-adiabatic photodissociation dynamics of BrCl
    Cao, Jianying
    Loock, Hans-Peter
    Qian, Charles X.W.
    Canadian Journal of Chemistry, 1994, 72 (03)
  • [26] NON-ADIABATIC PHOTODISSOCIATION DYNAMICS OF BRCL
    CAO, JY
    LOOCK, HP
    QIAN, CXW
    CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1994, 72 (03): : 758 - 761
  • [27] Non-adiabatic dynamics around a conical intersection with surface-hopping coupled coherent states
    Humeniuk, Alexander
    Mitric, Roland
    JOURNAL OF CHEMICAL PHYSICS, 2016, 144 (23):
  • [28] Non-adiabatic QM/MM: A hybrid approach to doing non-adiabatic excited state dynamics
    Tracy, Dustin
    Bjorgaard, Josiah
    Tretiak, Sergei
    Roitberg, Adrian
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
  • [29] Exciton Bimolecular Annihilation Dynamics in Push-Pull Semiconductor Polymers
    Zheng, Yulong
    Venkatesh, Rahul
    Rojas-Gatjens, Esteban
    Reichmanis, Elsa
    Silva-Acuna, Carlos
    JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2024, 15 (01): : 272 - 280
  • [30] Non-adiabatic transition probability dependence on conical intersection topography
    Malhado, Joao Pedro
    Hynes, James T.
    JOURNAL OF CHEMICAL PHYSICS, 2016, 145 (19):
12345